11G-019
TL;DR: 11G-019 (CAS 303150-39-2) is a chemical compound with molecular formula C14H10ClF3N6O2S and molecular weight 418.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-amino-2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: 11G-019, Ethyl 7-amino-2-((3-chloro-5-(trifluoromethyl)-2-pyridinyl)sulfanyl)(1,2,4)triazolo[1,5-a]pyrimidine-6-carboxylate, ethyl 7-amino-2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, ethyl 7-amino-2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, Ethyl 7-amino-2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio][1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
| Molecular Formula | C14H10ClF3N6O2S |
|---|---|
| Molecular Weight | 418.02 g/mol |
| LogP | 3.1016 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.02264 |
| Heavy Atoms | 27 |
| Complexity | 1025.9907 |
Chemical Identifiers
| CAS Number | 303150-39-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N2C(=NC(=N2)SC3=C(C=C(C=N3)C(F)(F)F)Cl)N=C1)N |
Product Overview
11G-019 (CAS 303150-39-2), with molecular formula C14H10ClF3N6O2S and molecular weight 418.02 g/mol. IUPAC: ethyl 7-amino-2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate.
Chemical Property Profile of 11G-019
Property Insights of 11G-019
The XLogP value of 3.1016 indicates that 11G-019 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 11G-019. Following Lipinski's Rule of Five, 11G-019 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11G-019?
The CAS number of 11G-019 is 303150-39-2.
What is the molecular formula of 11G-019?
The molecular formula of 11G-019 is C14H10ClF3N6O2S.
What is the molecular weight of 11G-019?
The molecular weight of 11G-019 is 418.02 g/mol.
Where can I buy 11G-019?
You can request a quote for 11G-019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11G-019?
Yes, KEHONG BIO provides custom synthesis services for 11G-019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.